2-(3,5-dimethylpyrazol-1-yl)-N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]acetamide

C18H25N5O — CID 124942990

IUPAC2-(3,5-dimethylpyrazol-1-yl)-N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]acetamide
SMILESCc1cccc(N2CCC[C@@H](NC(=O)Cn3nc(C)cc3C)C2)n1
InChIInChI=1S/C18H25N5O/c1-13-6-4-8-17(19-13)22-9-5-7-16(11-22)20-18(24)12-23-15(3)10-14(2)21-23/h4,6,8,10,16H,5,7,9,11-12H2,1-3H3,(H,20,24)/t16-/m1/s1
InChIKeyAZHLDLSRUCOZTA-MRXNPFEDSA-N
MW327.43 g/mol
LogP1.99
Rot. Bonds4

About 2-(3,5-dimethylpyrazol-1-yl)-N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]acetamide

2-(3,5-dimethylpyrazol-1-yl)-N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]acetamide (PubChem CID 124942990) has the molecular formula C18H25N5O and a molecular weight of 327.43 g/mol. Its IUPAC name is 2-(3,5-dimethylpyrazol-1-yl)-N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]acetamide.

Molecular Properties

Compound Name2-(3,5-dimethylpyrazol-1-yl)-N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]acetamide
PubChem CID124942990
Molecular FormulaC18H25N5O
Molecular Weight327.43 g/mol
Exact Mass327.21
IUPAC Name2-(3,5-dimethylpyrazol-1-yl)-N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]acetamide
SMILESCc1cccc(N2CCC[C@@H](NC(=O)Cn3nc(C)cc3C)C2)n1
InChIInChI=1S/C18H25N5O/c1-13-6-4-8-17(19-13)22-9-5-7-16(11-22)20-18(24)12-23-15(3)10-14(2)21-23/h4,6,8,10,16H,5,7,9,11-12H2,1-3H3,(H,20,24)/t16-/m1/s1
InChIKeyAZHLDLSRUCOZTA-MRXNPFEDSA-N
XLogP1.99
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(3,5-dimethylpyrazol-1-yl)-N-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]butanamide
CID 110107173
N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]acetamide
CID 124519191
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]acetamide
CID 124985226
tert-butyl N-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]carbamate
CID 133482310
3-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]propanamide
CID 124998129
2-methyl-N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]pyrazole-3-carboxamide
CID 125023608
4-ethyl-N-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]thiadiazole-5-carboxamide
CID 110107151
N-(azetidin-3-yl)-2-(3,5-dimethylpyrazol-1-yl)acetamide
CID 66185586
2-(3,5-dimethylpyrazol-1-yl)-N-pyrrolidin-3-ylacetamide;dihydrochloride
CID 119449670
2-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]acetamide
CID 124948305
1-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]ethanol
CID 86797293
2-(2-methylimidazol-1-yl)-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]acetamide
CID 124958753

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethylpyrazol-1-yl)-N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]acetamide?
The IUPAC name of 2-(3,5-dimethylpyrazol-1-yl)-N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]acetamide (CID 124942990) is 2-(3,5-dimethylpyrazol-1-yl)-N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]acetamide.
What is the SMILES notation for 2-(3,5-dimethylpyrazol-1-yl)-N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]acetamide?
The canonical SMILES for 2-(3,5-dimethylpyrazol-1-yl)-N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]acetamide is Cc1cccc(N2CCC[C@@H](NC(=O)Cn3nc(C)cc3C)C2)n1.
What is the InChIKey of 2-(3,5-dimethylpyrazol-1-yl)-N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]acetamide?
The InChIKey is AZHLDLSRUCOZTA-MRXNPFEDSA-N. The full InChI is InChI=1S/C18H25N5O/c1-13-6-4-8-17(19-13)22-9-5-7-16(11-22)20-18(24)12-23-15(3)10-14(2)21-23/h4,6,8,10,16H,5,7,9,11-12H2,1-3H3,(H,20,24)/t16-/m1/s1.
What are the key properties of 2-(3,5-dimethylpyrazol-1-yl)-N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]acetamide?
2-(3,5-dimethylpyrazol-1-yl)-N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]acetamide has a molecular weight of 327.43 g/mol, XLogP of 1.99, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethylpyrazol-1-yl)-N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]acetamide is sourced from PubChem (CID 124942990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).